SCHEMBL7095712

SCHEMBL7095712

COC(=O)CN1CC[C@H](NC(=O)OC(C)(C)C)CC1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.49
KCNA3 P22001 1/20 0.43
BTK Q06187 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
HSD11B1 P28845 2/20 0.40
CYP2C9 P11712 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
DRD2 P14416 3/20 0.39
GAA P10253 1/20 0.39
CKS1B P61024 1/20 0.38
SKP1 P63208 1/20 0.38
SKP2 Q13309 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
NAMPT P43490 1/20 0.37
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8234664 0.81 F2 (0.50) CTSKGAANFKB1NFKB2RELA
SCHEMBL8234659 0.81 F2 (0.50) CTSKGAANFKB1NFKB2RELA
SCHEMBL7586943 0.80 CTSK (0.51) CTSKKCNA3BTKCA1CA2
SCHEMBL17207700 0.78 CTSK (0.56) CTSKKCNA3BTKCA1CA2
SCHEMBL7098249 0.77 CA1 (0.46) CTSKKCNA3BTKCA1CA2
SCHEMBL30952422 0.76 CTSK (0.40) CTSKBTKCA1CA2HSD11B1
SCHEMBL12073066 0.75 CA1 (0.55) CTSKKCNA3BTKCA1CA2
SCHEMBL26109819 0.75 CA1 (0.55) CTSKKCNA3BTKCA1CA2
SCHEMBL12525646 0.75 MMP1 (0.55) GAA
SCHEMBL12494289 0.75 MMP1 (0.55) GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0815084-B1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE PROCTER & GAMBLE (US) 2003-08-27 EP disclosed
EP-0815084-A1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE THE PROCTER & GAMBLE COMPANY (US) 1998-01-07 EP disclosed
US-5672598-A MATRIX METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1997-09-30 US disclosed
WO-1996029313-A1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE THE PROCTER & GAMBLE COMPANY (US) 1996-09-26 WO disclosed